Geometry & MOs

Info

ID:	271392
PubChem CID:	103673719
Reduced:	FNC16H18 (1)
Stoich.:	ABC16D18 (1)
Weight, g/mol:	270.128075
ΔH_f, kcal/mol:	-17.81
Dipole, Da:	1.21
IP(EA), eV:	-9.05(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluoro-5-methylphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)methanamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNCC2=C(C=CC(=C2)C)F

DOS

IR

Vibrations